4-fluoro-3-methyl-N,N-dipropylbenzamide

C14H20FNO — CID 63212171

IUPAC4-fluoro-3-methyl-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1ccc(F)c(C)c1
InChIInChI=1S/C14H20FNO/c1-4-8-16(9-5-2)14(17)12-6-7-13(15)11(3)10-12/h6-7,10H,4-5,8-9H2,1-3H3
InChIKeyIYGPGMXAMKMCRW-UHFFFAOYSA-N
MW237.32 g/mol
LogP3.40
Rot. Bonds5

About 4-fluoro-3-methyl-N,N-dipropylbenzamide

4-fluoro-3-methyl-N,N-dipropylbenzamide (PubChem CID 63212171) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 4-fluoro-3-methyl-N,N-dipropylbenzamide.

Molecular Properties

Compound Name4-fluoro-3-methyl-N,N-dipropylbenzamide
PubChem CID63212171
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name4-fluoro-3-methyl-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1ccc(F)c(C)c1
InChIInChI=1S/C14H20FNO/c1-4-8-16(9-5-2)14(17)12-6-7-13(15)11(3)10-12/h6-7,10H,4-5,8-9H2,1-3H3
InChIKeyIYGPGMXAMKMCRW-UHFFFAOYSA-N
XLogP3.40
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-fluoro-3-methyl-N,N-dipropylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-bromoethyl)-4-fluoro-3-methyl-N-propylbenzamide
CID 80660124
N-butyl-4-fluoro-N-(2-hydroxyethyl)-3-methylbenzamide
CID 63213761
N-(3-aminopropyl)-3,4-difluoro-N-propylbenzamide
CID 43136548
N-(2-ethoxyethyl)-N-ethyl-4-fluoro-3-methylbenzamide
CID 63692679
4-fluoro-3-methyl-N-(piperidin-2-ylmethyl)-N-propylbenzamide
CID 106625701
N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide
CID 63213317
3-fluoro-4-methoxy-N,N-dipropylbenzamide
CID 86906434
2-[(3-chloro-4-fluorobenzoyl)-propylamino]acetic acid
CID 82875631
N-(3-aminopropyl)-4-fluoro-N-(2-methoxyethyl)-3-methylbenzamide
CID 63287370
3-methyl-4-nitro-N,N-dipropylbenzamide
CID 786985
4-bromo-N-(2-hydroxyethyl)-3-methyl-N-propylbenzamide
CID 112706331
N-(3-aminopropyl)-4-fluoro-N,3-dimethylbenzamide
CID 63209165

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3-methyl-N,N-dipropylbenzamide?
The IUPAC name of 4-fluoro-3-methyl-N,N-dipropylbenzamide (CID 63212171) is 4-fluoro-3-methyl-N,N-dipropylbenzamide.
What is the SMILES notation for 4-fluoro-3-methyl-N,N-dipropylbenzamide?
The canonical SMILES for 4-fluoro-3-methyl-N,N-dipropylbenzamide is CCCN(CCC)C(=O)c1ccc(F)c(C)c1.
What is the InChIKey of 4-fluoro-3-methyl-N,N-dipropylbenzamide?
The InChIKey is IYGPGMXAMKMCRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-4-8-16(9-5-2)14(17)12-6-7-13(15)11(3)10-12/h6-7,10H,4-5,8-9H2,1-3H3.
What are the key properties of 4-fluoro-3-methyl-N,N-dipropylbenzamide?
4-fluoro-3-methyl-N,N-dipropylbenzamide has a molecular weight of 237.32 g/mol, XLogP of 3.40, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3-methyl-N,N-dipropylbenzamide is sourced from PubChem (CID 63212171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).